Geometry & MOs

Info

ID:	203157
PubChem CID:	79788498
Reduced:	SN2O4C14H22 (1)
Stoich.:	AB2C4D14E22 (1)
Weight, g/mol:	270.119127
ΔH_f, kcal/mol:	-157.17
Dipole, Da:	5.6
IP(EA), eV:	-9.07(-0.44)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[[2-(tert-butylamino)-2-oxoethyl]amino]-3,3,3-trifluoro-2-methylpropanoic acid

Drug info:

PubChemData

Smile

CC(C)(C)NCC1=NC=C(C=C1)OC2CS(=O)(=O)CC2O

DOS

IR

Vibrations